J035-0424 Screening compound: N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-8,8-dimethyl-6-oxo-6H,7H,8H,9H-pyrazolo[1,5-a]quinazoline-3-carboxamide

J035-0424 Screening compound: N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-8,8-dimethyl-6-oxo-6H,7H,8H,9H-pyrazolo[1,5-a]quinazoline-3-carboxamide
J035-0424 Screening compound: N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-8,8-dimethyl-6-oxo-6H,7H,8H,9H-pyrazolo[1,5-a]quinazoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J035-0424
N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-8,8-dimethyl-6-oxo-6H,7H,8H,9H-pyrazolo[1,5-a]quinazoline-3-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

J035-0424

Molecular Formula

C26H31FN6O2 (C26 H31 FN6 O2)

Compound Name

N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-8,8-dimethyl-6-oxo-6H,7H,8H,9H-pyrazolo[1,5-a]quinazoline-3-carboxamide

IUPAC name

N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-88-dimethyl-6-oxo-6H7H8H9H-pyrazolo[15-a]quinazoline-3-carboxamide

SMILES

CC(C)(Cc(n1nc2)c3cnc1c2C(NCCCN(CC1)CCN1c(cccc1)c1F)=O)CC3=O

InChI

InChI=1S/C26H31FN6O2/c1-26(2)14-22-18(23(34)15-26)16-29-24-19(17-30-33(22)24)25(35)28-8-5-9-31-10-12-32(13-11-31)21-7-4-3-6-20(21)27/h3-4,6-7,16-17H,5,8-15H2,1-2H3,(H,28,35)

InChI Key

BTYIGAOKLFOBCZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27221638

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.932

Distribution Coefficient, logD

2.631

Water Solubility, LogSw

-3.52

Polar Surface Area

66.846

Acid Dissociation Constant (pKa)

13.14

Base Dissociation Constant (pKb)

7.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

References: we are preparing a list of scientific research reports with J035-0424 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J035-0424?
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What is the minimum amount of J035-0424 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J035-0424
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J035-0424
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of J035-0424 available by request